SCHEMBL30006844

SCHEMBL30006844

Cc1cc(C)c(S(=O)(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)c(C)c1

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 4/20 0.73
NR3C1 P04150 3/20 0.73
PGR P06401 3/20 0.73
MMP2 P08253 12/20 0.67
MMP9 P14780 12/20 0.67
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61
POLB P06746 1/20 0.61
KCNA5 P22460 1/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3123148 1.00 NR3C2 (0.73) NR3C2NR3C1PGRMMP2MMP9
SCHEMBL3134951 1.00 NR3C2 (0.73) NR3C2NR3C1PGRMMP2MMP9
SCHEMBL3123139 1.00 NR3C2 (0.73) NR3C2NR3C1PGRMMP2MMP9
SCHEMBL3131411 0.90 NR3C1 (0.70) NR3C2NR3C1PGRMMP2MMP9
SCHEMBL3131457 0.90 NR3C1 (0.70) NR3C2NR3C1PGRMMP2MMP9
SCHEMBL3131420 0.90 NR3C1 (0.70) NR3C2NR3C1PGRMMP2MMP9
SCHEMBL7301426 0.86 MMP9 (0.62) NR3C2NR3C1PGRMMP2MMP9
SCHEMBL3154749 0.85 MMP9 (0.88) NR3C1MMP2MMP9KMT2AMEN1
SCHEMBL3124795 0.85 NR3C1 (0.76) NR3C2NR3C1PGR
SCHEMBL3154764 0.85 MMP9 (0.88) NR3C1MMP2MMP9KMT2AMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11471868-B2 Redox dehydration coupling catalysts and methods related thereto EMORY UNIVERSITY (US) 2022-10-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11471868-B2 Redox dehydration coupling catalysts and methods related thereto SCLY, TST, SQOR NR3C2 1162/4885NR3C1 2928/4885PGR 4122/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.